Biphenyl, 2-nitro-3,3',4,4'-tetramethyl-
TL;DR: Biphenyl, 2-nitro-3,3',4,4'-tetramethyl- (CAS 21113-36-0) is a chemical compound with molecular formula C16H17NO2 and molecular weight 255.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3,4-dimethylphenyl)-3,4-dimethyl-2-nitrobenzene
Also Known As: Biphenyl, 2-nitro-3,3',4,4'-tetramethyl-, Biphenyl,2-nitro-3,3',4,4'-tetramethyl, Biphenyl, 2-nitro-3,3',4,4'-tetramethyl-,, 1-(3,4-dimethylphenyl)-3,4-dimethyl-2-nitrobenzene, 3,3',4,4'-TETRAMETHYL-2-NITRO-1,1'-BIPHENYL
| Molecular Formula | C16H17NO2 |
|---|---|
| Molecular Weight | 255.13 g/mol |
| LogP | 4.8 |
| Topological Polar Surface Area | 45.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 255.12593 |
| Heavy Atoms | 19 |
| Complexity | 325.0 |
Chemical Identifiers
| CAS Number | 21113-36-0 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)C2=C(C(=C(C=C2)C)C)[N+](=O)[O-])C |
| InChIKey | VZHFRRCMIRFSME-UHFFFAOYSA-N |
Product Overview
Biphenyl, 2-nitro-3,3',4,4'-tetramethyl- (CAS 21113-36-0), with molecular formula C16H17NO2 and molecular weight 255.13 g/mol. IUPAC: 1-(3,4-dimethylphenyl)-3,4-dimethyl-2-nitrobenzene.
Chemical Property Profile of Biphenyl, 2-nitro-3,3',4,4'-tetramethyl-
Property Insights of Biphenyl, 2-nitro-3,3',4,4'-tetramethyl-
The XLogP value of 4.8 indicates that Biphenyl, 2-nitro-3,3',4,4'-tetramethyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 45.8 Ų, Biphenyl, 2-nitro-3,3',4,4'-tetramethyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Biphenyl, 2-nitro-3,3',4,4'-tetramethyl- has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Biphenyl, 2-nitro-3,3',4,4'-tetramethyl-?
The CAS number of Biphenyl, 2-nitro-3,3',4,4'-tetramethyl- is 21113-36-0.
What is the molecular formula of Biphenyl, 2-nitro-3,3',4,4'-tetramethyl-?
The molecular formula of Biphenyl, 2-nitro-3,3',4,4'-tetramethyl- is C16H17NO2.
What is the molecular weight of Biphenyl, 2-nitro-3,3',4,4'-tetramethyl-?
The molecular weight of Biphenyl, 2-nitro-3,3',4,4'-tetramethyl- is 255.13 g/mol.
Where can I buy Biphenyl, 2-nitro-3,3',4,4'-tetramethyl-?
You can request a quote for Biphenyl, 2-nitro-3,3',4,4'-tetramethyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Biphenyl, 2-nitro-3,3',4,4'-tetramethyl-?
Yes, KEHONG BIO provides custom synthesis services for Biphenyl, 2-nitro-3,3',4,4'-tetramethyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.